N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine

C11H17N3O — CID 106395342

IUPACN-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine
SMILESc1nc(CCNC(C2CC2)C2CC2)no1
InChIInChI=1S/C11H17N3O/c1-2-8(1)11(9-3-4-9)12-6-5-10-13-7-15-14-10/h7-9,11-12H,1-6H2
InChIKeyWMKQHANKEPYGNB-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.39
Rot. Bonds6

About N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine

N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine (PubChem CID 106395342) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine
PubChem CID106395342
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine
SMILESc1nc(CCNC(C2CC2)C2CC2)no1
InChIInChI=1S/C11H17N3O/c1-2-8(1)11(9-3-4-9)12-6-5-10-13-7-15-14-10/h7-9,11-12H,1-6H2
InChIKeyWMKQHANKEPYGNB-UHFFFAOYSA-N
XLogP1.39
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]acetic acid
CID 106402019
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-4-propan-2-ylcyclohexan-1-amine
CID 106396755
N-cyclopentyl-2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]propanamide
CID 106401243
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclobutanamine
CID 106396081
1-cyclopropyl-N-(1,2,4-oxadiazol-3-ylmethyl)ethanamine
CID 106393050
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]but-3-yn-2-amine
CID 106400759
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]but-3-en-2-amine
CID 106400522
N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1-(4-propan-2-ylphenyl)ethanamine
CID 106395538
N-carbamoyl-2-[2-(1,2,4-oxadiazol-3-yl)ethylamino]propanamide
CID 106401246
2,6-dimethyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]cyclohexan-1-amine
CID 106395561
N-(dithiophen-2-ylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine
CID 106395635
5-[1-[2-(1,2,4-oxadiazol-3-yl)ethylamino]ethyl]benzene-1,3-diol
CID 106396467

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine?
The IUPAC name of N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine (CID 106395342) is N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine?
The canonical SMILES for N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine is c1nc(CCNC(C2CC2)C2CC2)no1.
What is the InChIKey of N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine?
The InChIKey is WMKQHANKEPYGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-2-8(1)11(9-3-4-9)12-6-5-10-13-7-15-14-10/h7-9,11-12H,1-6H2.
What are the key properties of N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine?
N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine has a molecular weight of 207.28 g/mol, XLogP of 1.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-2-(1,2,4-oxadiazol-3-yl)ethanamine is sourced from PubChem (CID 106395342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).